(2R)-N-(2-chloranyl-4-nitro-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide

Systemtic Name: (2R)-N-(2-chloranyl-4-nitro-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide Openeye Name: (2R)-N-(2-chloro-4-nitro-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide CAS Name: (2R)-N-(2-chloro-4-nitrophenyl)-2-(4-thieno[2,3-d]pyrimidinylthio)propanamide IUPAC Name: (2R)-N-(2-chloro-4-nitrophenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanamide Traditional Name: (2R)-N-(2-chloro-4-nitro-phenyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)propionamide Formula: C15H11ClN4O3S2 MolecularWeight: 394.85584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)SC2=NC=NC3=C2C=CS3

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)SC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C15H11ClN4O3S2/c1-8(25-15-10-4-5-24-14(10)17-7-18-15)13(21)19-12-3-2-9(20(22)23)6-11(12)16/h2-8H,1H3,(H,19,21)/t8-/m1/s1